#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g3g s GLU 2 N 0.00 0.59 1.01 1.61 0.41 -1.26 -5.17 118.70 115.89 1g3g s GLU 2 Ca 0.00 -0.88 -0.17 0.00 -0.41 0.00 0.00 54.97 53.52 1g3g s GLU 2 Cb 0.00 0.22 0.26 0.00 -1.78 0.00 0.00 34.13 32.83 1g3g s GLU 2 CO 0.00 -0.14 0.67 -1.71 -0.49 0.00 0.00 175.26 173.59 1g3g n ASN 3 N 0.61 -3.07 -4.09 -0.19 5.15 -1.26 -5.04 115.26 107.37 1g3g n ASN 3 Ca -0.18 -0.73 -0.27 0.00 -0.60 0.00 0.00 54.58 52.80 1g3g n ASN 3 Cb 0.59 -0.71 -0.17 0.00 -0.53 0.00 0.00 39.78 38.96 1g3g n ASN 3 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1g3g s ILE 4 N -1.97 1.47 -0.23 -1.44 -0.00 -1.26 -5.12 121.20 112.65 1g3g s ILE 4 Ca 0.49 -0.67 -0.18 0.00 -0.00 0.00 0.00 60.65 60.30 1g3g s ILE 4 Cb -0.07 -1.32 0.07 0.00 -0.00 0.00 0.00 42.46 41.13 1g3g s ILE 4 CO 0.40 0.43 0.60 0.42 -0.00 0.00 0.00 174.94 176.79 1g3g s THR 5 N 0.64 -0.00 -0.29 8.37 -4.23 -1.26 -5.16 115.64 113.70 1g3g s THR 5 Ca -0.14 0.02 -0.22 0.00 -1.18 0.00 0.00 61.69 60.17 1g3g s THR 5 Cb -0.16 -0.85 0.15 0.00 1.34 0.00 0.00 72.50 72.98 1g3g s THR 5 CO 0.04 0.01 1.14 0.00 -0.54 0.00 0.00 174.62 175.26 1g3g s GLN 6 N 0.90 0.32 -1.14 3.99 -2.07 -1.26 -5.09 119.66 115.31 1g3g s GLN 6 Ca -0.05 0.44 -0.22 0.00 -1.82 0.00 0.00 55.36 53.72 1g3g s GLN 6 Cb -0.05 0.12 -0.00 0.00 -1.09 0.00 0.00 33.01 31.99 1g3g s GLN 6 CO -0.08 -0.05 1.78 -1.25 -1.32 0.00 0.00 175.29 174.38 1g3g s PRO 7 N 0.57 3.18 0.06 9.60 0.04 -1.26 -4.80 135.00 142.39 1g3g s PRO 7 Ca -0.00 -1.27 -0.24 0.00 0.04 0.00 0.00 61.00 59.53 1g3g s PRO 7 Cb -0.04 -5.33 -0.16 0.00 0.04 0.00 0.00 34.50 29.01 1g3g s PRO 7 CO -0.11 -3.00 1.61 1.15 0.04 0.00 0.00 177.00 176.69 1g3g h THR 8 N 6.29 1.02 -0.39 1.26 2.02 -2.06 -3.45 112.91 117.60 1g3g h THR 8 Ca 0.27 -0.27 0.24 0.00 0.77 0.00 0.00 66.41 67.42 1g3g h THR 8 Cb 0.94 1.19 -0.24 0.00 -1.74 0.00 0.00 68.15 68.30 1g3g h THR 8 CO 1.33 0.07 0.34 -1.58 0.37 0.00 0.00 175.52 176.05 1g3g s GLN 9 N -5.70 0.13 0.31 6.66 0.74 -1.26 -5.16 119.66 115.39 1g3g s GLN 9 Ca -0.14 0.31 -0.28 0.00 0.05 0.00 0.00 55.36 55.30 1g3g s GLN 9 Cb 0.05 0.18 -0.09 0.00 1.10 0.00 0.00 33.01 34.24 1g3g s GLN 9 CO 0.65 -0.08 1.08 1.14 -0.55 0.00 0.00 175.29 177.54 1g3g s GLN 10 N 2.46 4.50 -0.49 1.67 -2.07 -1.26 -5.02 119.66 119.45 1g3g s GLN 10 Ca -0.02 1.72 0.03 0.00 -1.82 0.00 0.00 55.36 55.27 1g3g s GLN 10 Cb -0.05 -3.01 0.14 0.00 -1.09 0.00 0.00 33.01 29.00 1g3g s GLN 10 CO -0.14 0.11 0.28 -1.12 -1.32 0.00 0.00 175.29 173.10 1g3g s SER 11 N -1.07 3.77 -0.17 12.60 0.01 -1.26 -4.91 113.70 122.67 1g3g s SER 11 Ca 0.48 -2.88 0.14 0.00 1.31 0.00 0.00 55.95 55.00 1g3g s SER 11 Cb -0.29 -1.19 0.43 0.00 0.21 0.00 0.00 66.02 65.18 1g3g s SER 11 CO 0.37 -0.23 1.20 0.35 0.41 0.00 0.00 173.24 175.35 1g3g n THR 12 N 3.22 1.73 0.08 1.44 -2.24 -1.26 -4.79 114.28 112.46 1g3g n THR 12 Ca 0.11 -2.83 0.09 0.00 -2.27 0.00 0.00 64.05 59.15 1g3g n THR 12 Cb 0.35 -0.00 0.54 0.00 -2.10 0.00 0.00 70.33 69.12 1g3g n THR 12 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1g3g h GLN 13 N 1.13 0.26 -5.41 -0.78 4.15 -2.04 -3.36 115.11 109.06 1g3g h GLN 13 Ca -0.03 -0.02 -0.26 0.00 0.77 0.00 0.00 58.65 59.12 1g3g h GLN 13 Cb 1.24 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 28.84 1g3g h GLN 13 CO 0.08 0.17 0.83 0.00 -1.93 0.00 0.00 178.83 177.99 1g3g s ALA 14 N -5.27 1.51 0.00 3.38 0.00 -1.26 -3.75 121.76 116.36 1g3g s ALA 14 Ca -0.07 -1.95 0.00 0.00 0.00 0.00 0.00 51.96 49.94 1g3g s ALA 14 Cb 0.18 -4.67 0.00 0.00 0.00 0.00 0.00 23.12 18.63 1g3g s ALA 14 CO 0.71 -5.55 0.00 2.41 0.00 0.00 0.00 175.76 173.33 1g3g n THR 15 N 8.07 0.00 -0.23 0.00 -1.04 -1.26 -4.88 114.28 114.94 1g3g n THR 15 Ca 0.44 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 62.38 1g3g n THR 15 Cb 0.47 -0.15 0.04 0.00 -1.82 0.00 0.00 70.33 68.86 1g3g n THR 15 CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 1g3g h GLN 16 N 0.00 0.92 -1.00 -2.82 4.15 -1.90 -2.35 115.11 112.11 1g3g h GLN 16 Ca 0.00 -0.15 0.01 0.00 0.77 0.00 0.00 58.65 59.28 1g3g h GLN 16 Cb 0.00 -0.16 -0.05 0.00 0.21 0.00 0.00 27.48 27.48 1g3g h GLN 16 CO 0.00 0.76 0.66 0.00 -1.93 0.00 0.00 178.83 178.32 1g3g h ARG 17 N 0.87 1.32 -0.44 1.69 3.08 -1.92 -2.04 114.38 116.94 1g3g h ARG 17 Ca 0.21 -0.08 -0.07 0.00 0.07 0.00 0.00 59.98 60.11 1g3g h ARG 17 Cb 0.15 -0.30 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 1g3g h ARG 17 CO -0.02 0.87 -0.02 0.35 -1.07 0.00 0.00 179.97 180.08 1g3g h PHE 18 N 1.36 0.79 -0.59 3.04 3.57 -1.82 -2.64 116.94 120.63 1g3g h PHE 18 Ca 0.37 -0.11 -0.02 0.00 3.53 0.00 0.00 57.97 61.74 1g3g h PHE 18 Cb -0.15 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.34 1g3g h PHE 18 CO 0.00 0.75 0.30 -0.07 -2.23 0.00 0.00 178.31 177.05 1g3g h LEU 19 N 0.69 0.77 -0.49 0.59 4.07 -0.86 -2.41 115.31 117.67 1g3g h LEU 19 Ca 0.13 -0.12 -0.02 0.00 0.08 0.00 0.00 57.88 57.95 1g3g h LEU 19 Cb 0.46 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.98 1g3g h LEU 19 CO 0.02 0.67 0.21 0.40 -1.08 0.00 0.00 178.44 178.67 1g3g h ILE 20 N 0.81 1.20 -0.92 1.22 1.08 -1.26 -2.66 117.51 116.99 1g3g h ILE 20 Ca 0.21 -0.61 0.05 0.00 -0.39 0.00 0.00 64.86 64.12 1g3g h ILE 20 Cb 0.10 0.69 -0.06 0.00 -3.07 0.00 0.00 36.82 34.48 1g3g h ILE 20 CO -0.03 0.23 0.59 -0.33 -0.69 0.00 0.00 178.15 177.92 1g3g h GLU 21 N 0.65 1.06 0.00 2.37 5.08 -1.26 -1.06 114.58 121.43 1g3g h GLU 21 Ca 0.17 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.41 1g3g h GLU 21 Cb 0.16 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1g3g h GLU 21 CO -0.02 0.70 -0.25 0.87 -1.00 0.00 0.00 179.01 179.32 1g3g h LYS 22 N 1.09 0.00 -0.33 2.33 1.57 -1.16 -2.94 116.57 117.13 1g3g h LYS 22 Ca 0.39 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 59.20 1g3g h LYS 22 Cb 0.12 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 1g3g h LYS 22 CO -0.16 0.25 0.14 0.35 -0.57 0.00 0.00 179.45 179.47 1g3g h PHE 23 N 0.00 0.27 -0.92 -1.35 3.57 -0.85 -2.40 116.94 115.26 1g3g h PHE 23 Ca -0.00 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.57 1g3g h PHE 23 Cb 0.45 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 39.06 1g3g h PHE 23 CO 0.00 0.13 0.58 1.03 -2.23 0.00 0.00 178.31 177.82 1g3g h SER 24 N 0.31 0.93 -3.52 0.41 0.87 -1.49 -3.43 113.55 107.62 1g3g h SER 24 Ca 0.14 0.01 -0.19 0.00 -1.23 0.00 0.00 61.79 60.53 1g3g h SER 24 Cb 0.08 -0.19 0.05 0.00 -0.44 0.00 0.00 62.40 61.90 1g3g h SER 24 CO -0.12 0.60 0.11 0.00 -0.53 0.00 0.00 176.83 176.89 1g3g n GLN 25 N -4.56 -0.09 -1.90 2.24 1.13 -0.90 -5.02 117.38 108.27 1g3g n GLN 25 Ca 0.13 -1.00 -0.41 0.00 -1.94 0.00 0.00 57.00 53.78 1g3g n GLN 25 Cb 0.16 -0.42 -0.00 0.00 0.11 0.00 0.00 30.24 30.09 1g3g n GLN 25 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1g3g s GLU 26 N -3.85 4.11 -0.36 -1.09 2.02 -1.26 -4.94 118.70 113.34 1g3g s GLU 26 Ca 0.29 2.43 -0.29 0.00 0.02 0.00 0.00 54.97 57.43 1g3g s GLU 26 Cb -0.01 -2.94 0.02 0.00 0.10 0.00 0.00 34.13 31.30 1g3g s GLU 26 CO 0.20 -0.48 1.08 -0.65 0.02 0.00 0.00 175.26 175.44 1g3g s GLN 27 N -2.07 3.98 0.19 1.61 -0.21 -1.26 -4.89 119.66 117.01 1g3g s GLN 27 Ca 0.53 0.94 -0.28 0.00 0.02 0.00 0.00 55.36 56.57 1g3g s GLN 27 Cb -0.44 -3.78 -0.08 0.00 1.00 0.00 0.00 33.01 29.71 1g3g s GLN 27 CO 0.59 -1.01 0.86 0.42 -2.12 0.00 0.00 175.29 174.02 1g3g s ILE 28 N 3.82 4.25 -0.34 1.08 -1.09 -1.26 -4.96 121.20 122.69 1g3g s ILE 28 Ca 0.46 1.89 0.00 0.00 -2.23 0.00 0.00 60.65 60.77 1g3g s ILE 28 Cb -0.11 -4.23 0.30 0.00 -1.58 0.00 0.00 42.46 36.84 1g3g s ILE 28 CO 0.19 0.50 1.86 0.61 -1.23 0.00 0.00 174.94 176.87 1g3g n GLY 29 N 1.59 4.11 0.14 6.18 0.00 -1.26 -4.08 105.19 111.87 1g3g n GLY 29 Ca -0.04 -1.10 -0.21 0.00 0.00 0.00 0.00 46.02 44.68 1g3g n GLY 29 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1g3g h GLU 30 N 1.24 0.26 0.00 1.61 4.81 -1.92 -3.30 114.58 117.28 1g3g h GLU 30 Ca 0.36 -0.44 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1g3g h GLU 30 Cb 1.30 0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.85 1g3g h GLU 30 CO 0.83 1.17 -0.83 0.09 -0.73 0.00 0.00 179.01 179.55 1g3g n ASN 31 N -3.46 1.17 -4.55 1.04 3.02 -1.26 -4.00 115.26 107.22 1g3g n ASN 31 Ca -0.30 -0.50 -0.35 0.00 -0.03 0.00 0.00 54.58 53.40 1g3g n ASN 31 Cb 1.05 1.17 -0.04 0.00 -0.61 0.00 0.00 39.78 41.35 1g3g n ASN 31 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1g3g s ILE 32 N -2.24 3.39 0.12 2.41 -1.09 -1.26 -2.76 121.20 119.77 1g3g s ILE 32 Ca 0.01 0.05 -0.20 0.00 -2.23 0.00 0.00 60.65 58.28 1g3g s ILE 32 Cb 0.08 -3.99 -0.01 0.00 -1.58 0.00 0.00 42.46 36.96 1g3g s ILE 32 CO 0.44 -0.95 1.09 0.55 -1.23 0.00 0.00 174.94 174.84 1g3g n VAL 33 N 7.37 -0.46 -3.63 2.92 3.14 -0.96 -4.64 118.33 122.06 1g3g n VAL 33 Ca 0.25 1.70 -0.08 0.00 -2.96 0.00 0.00 64.34 63.26 1g3g n VAL 33 Cb 0.51 -2.13 -0.02 0.00 -1.06 0.00 0.00 33.84 31.14 1g3g n VAL 33 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1g3g s ARG 35 N -3.51 1.91 0.02 0.00 3.52 0.23 0.19 118.95 121.29 1g3g s ARG 35 Ca 0.07 -0.74 -0.19 0.00 -0.13 0.00 0.00 55.73 54.74 1g3g s ARG 35 Cb -0.02 -2.29 -0.06 0.00 -1.56 0.00 0.00 34.95 31.02 1g3g s ARG 35 CO -0.03 -0.41 0.55 0.54 -0.81 0.00 0.00 175.30 175.13 1g3g s VAL 36 N 1.46 4.88 -0.24 7.11 0.11 0.28 0.18 120.40 134.18 1g3g s VAL 36 Ca -0.00 1.15 -0.01 0.00 -2.93 0.00 0.00 61.98 60.19 1g3g s VAL 36 Cb -0.16 -3.88 0.07 0.00 -1.53 0.00 0.00 36.38 30.89 1g3g s VAL 36 CO -0.08 0.49 0.01 -0.63 -3.33 0.00 0.00 175.10 171.55 1g3g s ILE 37 N -0.60 1.11 -0.59 7.04 1.01 0.49 0.18 121.20 129.84 1g3g s ILE 37 Ca 0.29 -1.11 -0.20 0.00 0.00 0.00 0.00 60.65 59.63 1g3g s ILE 37 Cb -0.18 -1.57 0.09 0.00 0.01 0.00 0.00 42.46 40.80 1g3g s ILE 37 CO 0.17 -0.28 0.76 0.00 0.00 0.00 0.00 174.94 175.59 1g3g n THR 39 N 5.67 0.00 0.32 0.00 5.66 -1.26 -4.30 114.28 120.36 1g3g n THR 39 Ca -0.07 -0.32 0.19 0.00 -3.05 0.00 0.00 64.05 60.80 1g3g n THR 39 Cb 0.44 0.30 1.02 0.00 -1.55 0.00 0.00 70.33 70.54 1g3g n THR 39 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 175.07 172.73 1g3g h THR 40 N 0.00 0.00 0.00 1.09 1.35 -1.89 -3.45 112.91 110.01 1g3g h THR 40 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1g3g h THR 40 Cb 0.65 0.83 0.00 0.00 -1.73 0.00 0.00 68.15 67.90 1g3g h THR 40 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1g3g n GLY 41 N -1.15 0.68 2.06 5.82 0.00 -1.26 -4.93 105.19 106.42 1g3g n GLY 41 Ca -0.02 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.26 1g3g n GLY 41 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1g3g n GLN 42 N 0.00 0.00 -4.11 1.61 6.02 -1.26 -5.09 117.38 114.55 1g3g n GLN 42 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 56.85 1g3g n GLN 42 Cb 0.00 0.00 -0.11 0.00 1.02 0.00 0.00 30.24 31.15 1g3g n GLN 42 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1g3g s ILE 43 N -2.00 0.71 0.37 5.09 -1.09 -1.26 -5.13 121.20 117.89 1g3g s ILE 43 Ca 0.00 -1.26 -0.23 0.00 -2.23 0.00 0.00 60.65 56.93 1g3g s ILE 43 Cb 0.00 -0.88 -0.10 0.00 -1.58 0.00 0.00 42.46 39.90 1g3g s ILE 43 CO 0.00 -0.42 0.93 -2.16 -1.23 0.00 0.00 174.94 172.07 1g3g s PRO 44 N -1.95 4.38 -0.24 2.79 0.04 -1.26 -3.96 135.00 134.80 1g3g s PRO 44 Ca -0.05 1.19 -0.39 0.00 0.04 0.00 0.00 61.00 61.79 1g3g s PRO 44 Cb -0.08 -2.49 -0.18 0.00 0.04 0.00 0.00 34.50 31.80 1g3g s PRO 44 CO 0.00 0.13 1.20 -0.89 0.04 0.00 0.00 177.00 177.49 1g3g n ILE 45 N -0.05 0.00 -4.31 0.56 5.41 -1.26 -4.67 119.36 115.04 1g3g n ILE 45 Ca 0.04 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.52 1g3g n ILE 45 Cb 0.52 -0.24 -0.10 0.00 -0.71 0.00 0.00 39.64 39.11 1g3g n ILE 45 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1g3g s ARG 46 N 1.44 1.97 -0.20 0.38 0.52 0.13 -5.00 118.95 118.18 1g3g s ARG 46 Ca 0.87 -1.29 -0.01 0.00 -0.52 0.00 0.00 55.73 54.78 1g3g s ARG 46 Cb -1.24 -2.12 0.01 0.00 0.52 0.00 0.00 34.95 32.13 1g3g s ARG 46 CO 0.63 0.43 -0.12 0.16 0.02 0.00 0.00 175.30 176.42 1g3g s ASP 47 N -2.74 3.69 -0.24 0.23 -4.77 -1.26 -0.56 116.67 111.03 1g3g s ASP 47 Ca 0.24 -0.54 -0.14 0.00 -3.30 0.00 0.00 52.55 48.81 1g3g s ASP 47 Cb -0.09 -1.60 -0.04 0.00 -1.09 0.00 0.00 42.92 40.10 1g3g s ASP 47 CO 0.14 -0.01 0.31 -0.76 0.70 0.00 0.00 175.17 175.55 1g3g s LEU 48 N 1.38 4.10 0.21 2.11 1.43 0.50 -4.94 118.68 123.46 1g3g s LEU 48 Ca 0.05 0.30 0.07 0.00 -1.03 0.00 0.00 54.13 53.52 1g3g s LEU 48 Cb -0.14 -2.35 -0.05 0.00 0.03 0.00 0.00 46.19 43.69 1g3g s LEU 48 CO -0.08 -0.07 -0.12 -0.44 0.23 0.00 0.00 176.35 175.87 1g3g s SER 49 N 1.28 2.43 -0.19 2.29 0.01 -1.26 0.80 113.70 119.05 1g3g s SER 49 Ca 0.14 -1.05 -0.23 0.00 1.31 0.00 0.00 55.95 56.11 1g3g s SER 49 Cb -0.15 -0.11 0.06 0.00 0.21 0.00 0.00 66.02 66.03 1g3g s SER 49 CO 0.08 -0.24 0.63 0.00 0.41 0.00 0.00 173.24 174.12 1g3g s ALA 50 N -3.06 -1.57 0.11 1.44 0.00 -1.11 -4.61 121.76 112.96 1g3g s ALA 50 Ca 0.23 1.64 -0.31 0.00 0.00 0.00 0.00 51.96 53.51 1g3g s ALA 50 Cb 0.01 -0.80 -0.08 0.00 0.00 0.00 0.00 23.12 22.25 1g3g s ALA 50 CO 0.06 -0.31 1.40 -0.51 0.00 0.00 0.00 175.76 176.40 1g3g s ASP 51 N -0.02 6.81 0.26 0.00 1.01 -1.26 -4.37 116.67 119.09 1g3g s ASP 51 Ca -0.03 2.34 -0.05 0.00 0.71 0.00 0.00 52.55 55.52 1g3g s ASP 51 Cb -0.04 -2.59 0.30 0.00 1.01 0.00 0.00 42.92 41.61 1g3g s ASP 51 CO 0.03 -0.66 1.86 0.40 0.21 0.00 0.00 175.17 177.00 1g3g h ILE 52 N 4.26 1.24 -0.60 0.77 2.04 -1.94 -2.40 117.51 120.87 1g3g h ILE 52 Ca -0.42 -0.67 0.09 0.00 1.00 0.00 0.00 64.86 64.86 1g3g h ILE 52 Cb 1.21 0.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.50 1g3g h ILE 52 CO 0.87 0.29 0.40 0.77 0.00 0.00 0.00 178.15 180.48 1g3g h SER 53 N 1.09 0.42 -0.41 1.72 4.64 -1.98 0.58 113.55 119.61 1g3g h SER 53 Ca 0.27 0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.57 1g3g h SER 53 Cb 0.10 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.09 1g3g h SER 53 CO -0.03 0.26 0.15 1.56 -0.87 0.00 0.00 176.83 177.90 1g3g h GLN 54 N 0.47 0.62 -0.09 4.77 4.20 -1.77 -1.32 115.11 122.00 1g3g h GLN 54 Ca 0.27 -0.12 -0.17 0.00 0.06 0.00 0.00 58.65 58.69 1g3g h GLN 54 Cb 0.46 -0.10 0.01 0.00 0.30 0.00 0.00 27.48 28.16 1g3g h GLN 54 CO -0.08 0.60 -0.62 0.28 -0.67 0.00 0.00 178.83 178.33 1g3g h VAL 55 N 0.52 1.35 -0.62 -0.54 2.07 -1.36 1.01 116.25 118.69 1g3g h VAL 55 Ca 0.14 -1.93 0.04 0.00 0.82 0.00 0.00 66.70 65.76 1g3g h VAL 55 Cb 0.21 2.23 -0.03 0.00 -1.52 0.00 0.00 31.29 32.18 1g3g h VAL 55 CO -0.01 0.59 0.41 -0.07 0.02 0.00 0.00 177.57 178.50 1g3g h LEU 56 N 0.19 0.61 0.04 2.57 4.07 -0.87 -3.11 115.31 118.82 1g3g h LEU 56 Ca -0.05 -0.01 -0.35 0.00 0.08 0.00 0.00 57.88 57.55 1g3g h LEU 56 Cb 1.28 -0.14 -0.04 0.00 1.08 0.00 0.00 40.66 42.83 1g3g h LEU 56 CO 0.13 0.42 -2.00 1.17 -1.08 0.00 0.00 178.44 177.08 1g3g n LYS 57 N -4.46 0.65 -3.15 1.13 3.00 -0.50 -5.05 118.16 109.78 1g3g n LYS 57 Ca 0.08 0.33 -0.03 0.00 -0.00 0.00 0.00 58.31 58.68 1g3g n LYS 57 Cb 0.14 -1.64 0.00 0.00 0.00 0.00 0.00 35.03 33.54 1g3g n LYS 57 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1g3g n GLU 58 N -3.84 -1.37 0.00 1.64 0.00 0.35 -4.86 120.64 112.56 1g3g n GLU 58 Ca -0.39 1.39 0.00 0.00 0.00 0.00 0.00 57.16 58.16 1g3g n GLU 58 Cb 0.91 -5.36 0.00 0.00 0.00 0.00 0.00 31.44 26.99 1g3g n GLU 58 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 1g3g n LYS 59 N -1.92 0.00 0.00 5.31 0.00 -1.26 -4.98 118.16 115.31 1g3g n LYS 59 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.27 1g3g n LYS 59 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.56 1g3g n LYS 59 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 1g3g n ARG 60 N -0.84 0.00 -3.10 1.64 3.00 -1.26 -4.66 116.66 111.44 1g3g n ARG 60 Ca 0.00 0.42 -0.20 0.00 -0.00 0.00 0.00 57.85 58.07 1g3g n ARG 60 Cb 0.00 -1.35 -0.04 0.00 0.00 0.00 0.00 32.46 31.08 1g3g n ARG 60 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 1g3g n SER 61 N -1.75 -0.34 -2.27 6.15 7.64 -1.26 -4.97 113.62 116.82 1g3g n SER 61 Ca 0.00 -2.87 -0.28 0.00 1.01 0.00 0.00 58.87 56.72 1g3g n SER 61 Cb 0.00 -0.13 0.04 0.00 -1.01 0.00 0.00 64.21 63.11 1g3g n SER 61 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1g3g n ILE 62 N 1.26 3.30 -3.22 0.44 3.06 -1.26 -4.60 119.36 118.33 1g3g n ILE 62 Ca 0.19 -2.66 -0.24 0.00 -2.50 0.00 0.00 62.75 57.54 1g3g n ILE 62 Cb 0.57 -1.28 -0.07 0.00 0.54 0.00 0.00 39.64 39.39 1g3g n ILE 62 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 1g3g n LYS 63 N -0.22 0.72 -4.70 9.51 5.02 -1.26 -4.22 118.16 123.01 1g3g n LYS 63 Ca 0.49 -3.27 -0.33 0.00 -2.02 0.00 0.00 58.31 53.18 1g3g n LYS 63 Cb 0.57 -1.30 -0.14 0.00 -0.02 0.00 0.00 35.03 34.14 1g3g n LYS 63 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1g3g s LYS 64 N -1.09 3.38 -0.00 1.97 2.20 -1.16 -5.01 119.74 120.02 1g3g s LYS 64 Ca 0.35 -0.65 0.01 0.00 -0.36 0.00 0.00 55.97 55.32 1g3g s LYS 64 Cb 0.15 -2.67 -0.00 0.00 -1.51 0.00 0.00 37.83 33.80 1g3g s LYS 64 CO -0.12 0.25 -0.03 0.08 -0.36 0.00 0.00 175.35 175.18 1g3g s VAL 65 N 0.26 0.26 -0.13 4.02 1.01 -1.26 0.51 120.40 125.07 1g3g s VAL 65 Ca -0.08 -0.13 -0.07 0.00 0.00 0.00 0.00 61.98 61.70 1g3g s VAL 65 Cb -0.15 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.96 1g3g s VAL 65 CO 0.05 0.08 0.14 0.26 0.00 0.00 0.00 175.10 175.62 1g3g s TRP 66 N -0.02 3.58 -0.05 5.22 0.51 0.51 -4.89 118.94 123.81 1g3g s TRP 66 Ca 0.01 0.51 0.02 0.00 -2.12 0.00 0.00 56.10 54.51 1g3g s TRP 66 Cb -0.02 -1.96 0.02 0.00 -0.81 0.00 0.00 33.47 30.70 1g3g s TRP 66 CO -0.00 0.70 -0.08 0.99 -0.51 0.00 0.00 176.95 178.05 1g3g s THR 67 N -0.92 0.82 -0.28 2.01 2.01 -1.26 0.21 115.64 118.24 1g3g s THR 67 Ca 0.14 -0.31 -0.10 0.00 0.31 0.00 0.00 61.69 61.74 1g3g s THR 67 Cb -0.12 -0.78 -0.04 0.00 0.01 0.00 0.00 72.50 71.57 1g3g s THR 67 CO 0.04 0.28 0.15 -0.36 -0.69 0.00 0.00 174.62 174.04 1g3g s PHE 68 N 0.71 3.17 -5.00 4.92 0.40 0.31 0.30 117.98 122.79 1g3g s PHE 68 Ca -0.12 -0.13 0.00 0.00 -0.60 0.00 0.00 56.93 56.08 1g3g s PHE 68 Cb -0.14 -2.34 0.00 0.00 0.51 0.00 0.00 43.02 41.05 1g3g s PHE 68 CO 0.02 -0.26 0.00 0.41 0.70 0.00 0.00 175.22 176.09 1g3g n GLY 69 N 5.01 -0.27 3.56 4.36 0.00 -1.23 -0.03 105.19 116.59 1g3g n GLY 69 Ca -0.15 -1.27 -0.38 0.00 0.00 0.00 0.00 46.02 44.23 1g3g n GLY 69 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1g3g s ARG 70 N -2.00 3.19 0.06 1.61 1.70 -0.78 -3.63 118.95 119.11 1g3g s ARG 70 Ca 0.00 -0.58 -0.11 0.00 -0.47 0.00 0.00 55.73 54.56 1g3g s ARG 70 Cb 0.00 -4.95 0.01 0.00 -0.57 0.00 0.00 34.95 29.44 1g3g s ARG 70 CO 0.00 -2.50 0.25 -0.80 -1.08 0.00 0.00 175.30 171.17 1g3g s ASN 71 N 5.66 -0.02 0.25 -2.89 -0.87 -1.26 -4.65 114.94 111.16 1g3g s ASN 71 Ca 0.51 -0.37 0.09 0.00 -1.57 0.00 0.00 52.86 51.51 1g3g s ASN 71 Cb -0.04 0.34 0.48 0.00 -0.02 0.00 0.00 41.25 42.00 1g3g s ASN 71 CO 0.00 -0.64 1.12 -2.65 -2.57 0.00 0.00 177.10 172.36 1g3g n PRO 72 N 0.39 0.06 0.00 -0.60 -0.02 -1.26 -4.06 135.00 129.51 1g3g n PRO 72 Ca -0.18 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 1g3g n PRO 72 Cb 0.60 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 1g3g n PRO 72 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1g3g n ALA 73 N -1.46 0.00 0.01 3.55 0.00 -1.26 -4.38 120.51 116.97 1g3g n ALA 73 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.42 1g3g n ALA 73 Cb 0.35 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.79 1g3g n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1g3g n ASP 75 N -2.62 1.88 -3.78 0.00 2.03 0.88 -4.52 116.55 110.42 1g3g n ASP 75 Ca -0.01 0.42 -0.13 0.00 0.52 0.00 0.00 54.79 55.59 1g3g n ASP 75 Cb 0.03 -0.91 -0.10 0.00 -0.72 0.00 0.00 41.12 39.41 1g3g n ASP 75 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 1g3g s TYR 76 N -2.41 -0.25 -0.53 -0.67 -0.85 -1.22 -4.96 117.35 106.47 1g3g s TYR 76 Ca -0.30 0.55 -0.22 0.00 -0.52 0.00 0.00 57.07 56.58 1g3g s TYR 76 Cb 0.08 0.09 0.05 0.00 0.38 0.00 0.00 41.96 42.56 1g3g s TYR 76 CO 0.53 -0.24 0.79 -1.58 -1.52 0.00 0.00 175.55 173.53 1g3g s HIS 77 N -0.42 2.92 0.44 -3.49 5.65 -1.26 -3.98 115.29 115.15 1g3g s HIS 77 Ca -0.05 -0.25 0.03 0.00 0.25 0.00 0.00 55.06 55.04 1g3g s HIS 77 Cb -0.04 -3.80 -0.02 0.00 -1.18 0.00 0.00 32.58 27.54 1g3g s HIS 77 CO 0.02 -1.19 0.10 -0.48 -0.65 0.00 0.00 174.74 172.54 1g3g s LEU 78 N 3.31 2.06 0.90 8.88 2.34 -1.24 -4.92 118.68 130.01 1g3g s LEU 78 Ca 0.23 -1.70 -0.14 0.00 0.06 0.00 0.00 54.13 52.59 1g3g s LEU 78 Cb -0.16 -0.24 0.00 0.00 -0.56 0.00 0.00 46.19 45.24 1g3g s LEU 78 CO 0.16 -0.94 0.34 0.61 -1.06 0.00 0.00 176.35 175.46 1g3g n GLY 79 N -1.02 -2.11 3.14 -3.48 0.00 -1.26 -4.43 105.19 96.03 1g3g n GLY 79 Ca -0.10 -0.66 -0.37 0.00 0.00 0.00 0.00 46.02 44.89 1g3g n GLY 79 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g3g s ASN 80 N -1.80 5.36 -0.11 1.61 2.20 -1.26 -4.13 114.94 116.80 1g3g s ASN 80 Ca 0.58 -2.06 0.01 0.00 -0.94 0.00 0.00 52.86 50.45 1g3g s ASN 80 Cb -0.24 -1.87 -0.01 0.00 -2.00 0.00 0.00 41.25 37.12 1g3g s ASN 80 CO 0.66 -0.57 -0.15 -0.63 -2.94 0.00 0.00 177.10 173.48 1g3g s ILE 81 N 1.11 2.91 0.61 0.54 1.01 -1.26 -4.85 121.20 121.27 1g3g s ILE 81 Ca 0.08 -0.72 0.29 0.00 0.00 0.00 0.00 60.65 60.30 1g3g s ILE 81 Cb -0.23 -2.20 0.35 0.00 0.01 0.00 0.00 42.46 40.39 1g3g s ILE 81 CO -0.03 0.54 1.91 0.28 0.00 0.00 0.00 174.94 177.63 1g3g h SER 82 N 6.48 0.00 0.00 3.58 0.02 -1.97 -2.59 113.55 119.06 1g3g h SER 82 Ca -0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 1g3g h SER 82 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1g3g h SER 82 CO 0.54 0.00 0.00 0.54 -1.14 0.00 0.00 176.83 176.77 1g3g n ARG 83 N -3.46 0.00 -3.74 3.45 1.74 -1.26 -4.78 116.66 108.60 1g3g n ARG 83 Ca 0.05 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.75 1g3g n ARG 83 Cb 0.56 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 31.88 1g3g n ARG 83 CO 0.00 0.00 0.00 -0.48 -1.52 0.00 0.00 177.63 175.63 1g3g s LEU 84 N 0.00 4.39 0.00 0.55 2.34 -1.25 -4.35 118.68 120.35 1g3g s LEU 84 Ca 0.00 -1.18 0.00 0.00 0.06 0.00 0.00 54.13 53.01 1g3g s LEU 84 Cb 0.00 -1.87 0.00 0.00 -0.56 0.00 0.00 46.19 43.76 1g3g s LEU 84 CO 0.00 -0.34 0.00 -1.20 -1.06 0.00 0.00 176.35 173.75 1g3g n SER 85 N 4.81 0.00 -3.66 1.48 7.64 -1.25 -4.62 113.62 118.02 1g3g n SER 85 Ca -0.12 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.76 1g3g n SER 85 Cb 0.44 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 1g3g n SER 85 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1g3g n ASN 86 N 0.00 -0.10 -4.06 6.43 4.13 -0.97 -1.86 115.26 118.83 1g3g n ASN 86 Ca 0.00 -0.02 -0.27 0.00 1.68 0.00 0.00 54.58 55.97 1g3g n ASN 86 Cb 0.00 0.00 -0.11 0.00 -1.54 0.00 0.00 39.78 38.13 1g3g n ASN 86 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1g3g n LYS 87 N -0.12 0.04 0.19 3.52 4.01 -1.26 -3.36 118.16 121.18 1g3g n LYS 87 Ca 0.00 -1.28 0.12 0.00 -0.51 0.00 0.00 58.31 56.65 1g3g n LYS 87 Cb 0.00 -3.10 0.25 0.00 -0.51 0.00 0.00 35.03 31.67 1g3g n LYS 87 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 1g3g h HIS 88 N 10.69 0.00 -1.42 2.13 2.76 -0.45 -3.38 115.15 125.47 1g3g h HIS 88 Ca 0.12 0.00 0.23 0.00 -2.20 0.00 0.00 60.37 58.51 1g3g h HIS 88 Cb 0.85 0.00 -0.21 0.00 1.55 0.00 0.00 27.41 29.60 1g3g h HIS 88 CO 1.02 0.00 0.80 0.12 -1.30 0.00 0.00 177.93 178.57 1g3g s PHE 89 N -3.20 -0.15 0.08 5.26 5.36 0.20 -2.69 117.98 122.85 1g3g s PHE 89 Ca 0.08 0.15 0.00 0.00 -0.96 0.00 0.00 56.93 56.19 1g3g s PHE 89 Cb 0.07 0.50 -0.04 0.00 -0.34 0.00 0.00 43.02 43.21 1g3g s PHE 89 CO 0.64 -0.19 -0.03 -0.65 -1.46 0.00 0.00 175.22 173.53 1g3g s GLN 90 N -2.00 0.75 -0.06 10.12 -0.21 0.22 0.11 119.66 128.60 1g3g s GLN 90 Ca 0.08 -1.30 0.02 0.00 0.02 0.00 0.00 55.36 54.17 1g3g s GLN 90 Cb -0.01 0.03 0.02 0.00 1.00 0.00 0.00 33.01 34.04 1g3g s GLN 90 CO -0.05 -0.09 -0.10 0.42 -2.12 0.00 0.00 175.29 173.35 1g3g s ILE 91 N -3.80 0.97 -0.03 1.08 1.01 0.57 0.65 121.20 121.65 1g3g s ILE 91 Ca 0.11 -0.38 -0.02 0.00 0.00 0.00 0.00 60.65 60.37 1g3g s ILE 91 Cb 0.07 -0.91 -0.04 0.00 0.01 0.00 0.00 42.46 41.59 1g3g s ILE 91 CO -0.06 0.32 0.08 -0.76 0.00 0.00 0.00 174.94 174.52 1g3g s LEU 92 N 0.74 3.94 -0.12 2.97 1.43 0.52 0.19 118.68 128.36 1g3g s LEU 92 Ca -0.14 0.20 0.01 0.00 -1.03 0.00 0.00 54.13 53.17 1g3g s LEU 92 Cb -0.15 -2.19 0.02 0.00 0.03 0.00 0.00 46.19 43.89 1g3g s LEU 92 CO 0.03 0.31 -0.13 -0.22 0.23 0.00 0.00 176.35 176.57 1g3g s LEU 93 N -1.52 1.57 0.00 1.79 1.98 0.18 0.15 118.68 122.83 1g3g s LEU 93 Ca 0.21 -0.40 0.00 0.00 -2.89 0.00 0.00 54.13 51.04 1g3g s LEU 93 Cb -0.12 -1.03 0.00 0.00 0.66 0.00 0.00 46.19 45.70 1g3g s LEU 93 CO 0.11 -0.04 0.00 0.61 -1.89 0.00 0.00 176.35 175.14 1g3g n GLY 94 N 4.53 0.79 5.09 7.98 0.00 -1.24 -2.99 105.19 119.35 1g3g n GLY 94 Ca -0.17 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.71 1g3g n GLY 94 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1g3g n GLU 95 N 0.00 0.00 -2.67 1.61 4.07 -1.26 -3.14 120.64 119.25 1g3g n GLU 95 Ca 0.00 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 57.06 1g3g n GLU 95 Cb 0.00 0.00 0.09 0.00 -0.06 0.00 0.00 31.44 31.47 1g3g n GLU 95 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1g3g n ASP 96 N 1.51 -1.34 0.00 4.31 2.03 -1.26 -5.14 116.55 116.66 1g3g n ASP 96 Ca 0.00 -1.91 0.00 0.00 0.52 0.00 0.00 54.79 53.40 1g3g n ASP 96 Cb 0.00 0.98 0.00 0.00 -0.72 0.00 0.00 41.12 41.38 1g3g n ASP 96 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1g3g n GLY 97 N 1.02 0.28 5.05 0.27 0.00 -1.19 -5.07 105.19 105.55 1g3g n GLY 97 Ca -0.02 -1.38 0.05 0.00 0.00 0.00 0.00 46.02 44.68 1g3g n GLY 97 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1g3g n ASN 98 N -0.28 -5.62 -4.80 1.61 3.02 -1.26 -4.87 115.26 103.05 1g3g n ASN 98 Ca 0.00 0.43 -0.22 0.00 -0.03 0.00 0.00 54.58 54.76 1g3g n ASN 98 Cb 0.00 -1.21 -0.05 0.00 -0.61 0.00 0.00 39.78 37.91 1g3g n ASN 98 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1g3g s LEU 99 N 0.00 3.72 0.10 3.41 1.02 -1.26 -3.67 118.68 122.00 1g3g s LEU 99 Ca 0.00 -0.31 0.10 0.00 0.02 0.00 0.00 54.13 53.94 1g3g s LEU 99 Cb 0.00 -2.26 -0.03 0.00 0.02 0.00 0.00 46.19 43.92 1g3g s LEU 99 CO 0.00 -0.04 -0.25 -0.76 0.02 0.00 0.00 176.35 175.32 1g3g s LEU 100 N -3.82 2.26 -0.14 1.79 1.02 0.39 -1.56 118.68 118.63 1g3g s LEU 100 Ca 0.33 -0.68 0.01 0.00 0.02 0.00 0.00 54.13 53.81 1g3g s LEU 100 Cb -0.08 -1.17 -0.00 0.00 0.02 0.00 0.00 46.19 44.96 1g3g s LEU 100 CO 0.24 0.18 -0.17 -0.76 0.02 0.00 0.00 176.35 175.86 1g3g s LEU 101 N -1.74 2.42 -0.29 1.79 1.02 0.36 0.20 118.68 122.44 1g3g s LEU 101 Ca 0.12 -0.47 -0.03 0.00 0.02 0.00 0.00 54.13 53.77 1g3g s LEU 101 Cb -0.10 -1.53 0.04 0.00 0.02 0.00 0.00 46.19 44.62 1g3g s LEU 101 CO 0.04 0.12 0.00 0.21 0.02 0.00 0.00 176.35 176.74 1g3g s ASN 102 N 0.61 4.82 -0.43 2.29 2.47 0.21 0.18 114.94 125.08 1g3g s ASN 102 Ca -0.10 -1.13 -0.26 0.00 0.42 0.00 0.00 52.86 51.80 1g3g s ASN 102 Cb -0.16 -1.73 0.02 0.00 -1.45 0.00 0.00 41.25 37.94 1g3g s ASN 102 CO 0.03 -0.23 0.95 -1.81 -3.72 0.00 0.00 177.10 172.32 1g3g s ASP 103 N 1.30 6.58 -0.26 -4.21 1.01 -1.24 0.73 116.67 120.58 1g3g s ASP 103 Ca -0.03 0.32 0.02 0.00 0.71 0.00 0.00 52.55 53.57 1g3g s ASP 103 Cb -0.19 -2.47 0.07 0.00 1.01 0.00 0.00 42.92 41.34 1g3g s ASP 103 CO -0.01 -1.01 -0.04 -0.51 0.21 0.00 0.00 175.17 173.80 1g3g s ILE 104 N 3.75 1.81 0.29 0.77 2.07 -1.24 0.79 121.20 129.44 1g3g s ILE 104 Ca 0.39 -1.54 0.02 0.00 -1.41 0.00 0.00 60.65 58.11 1g3g s ILE 104 Cb -0.10 -2.08 -0.05 0.00 0.13 0.00 0.00 42.46 40.36 1g3g s ILE 104 CO 0.24 -0.20 0.10 -0.44 -1.91 0.00 0.00 174.94 172.74 1g3g s SER 105 N 1.24 1.64 -0.01 4.50 0.01 -1.09 0.60 113.70 120.58 1g3g s SER 105 Ca -0.03 -1.44 -0.13 0.00 1.31 0.00 0.00 55.95 55.66 1g3g s SER 105 Cb -0.19 0.18 -0.07 0.00 0.21 0.00 0.00 66.02 66.15 1g3g s SER 105 CO -0.07 -0.75 0.71 0.74 0.41 0.00 0.00 173.24 174.28 1g3g h THR 106 N 2.24 0.00 0.00 1.44 2.02 -1.85 -3.43 112.91 113.33 1g3g h THR 106 Ca -0.38 -0.31 -0.14 0.00 0.77 0.00 0.00 66.41 66.36 1g3g h THR 106 Cb 1.25 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 1g3g h THR 106 CO 0.61 0.00 -1.52 -0.46 0.37 0.00 0.00 175.52 174.52 1g3g n ASN 107 N -4.09 3.19 -3.73 4.18 0.23 -1.26 -5.05 115.26 108.73 1g3g n ASN 107 Ca -0.06 -0.01 -0.13 0.00 -0.53 0.00 0.00 54.58 53.85 1g3g n ASN 107 Cb 0.18 0.45 -0.13 0.00 -2.08 0.00 0.00 39.78 38.19 1g3g n ASN 107 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1g3g s GLY 108 N -4.20 -0.12 -0.03 4.83 0.00 -1.26 -5.02 107.32 101.51 1g3g s GLY 108 Ca -0.06 0.93 0.07 0.00 0.00 0.00 0.00 44.72 45.66 1g3g s GLY 108 CO 0.28 1.27 -0.24 -1.59 0.00 0.00 0.00 173.10 172.82 1g3g s THR 109 N 1.35 1.93 0.11 0.90 2.01 -1.26 -4.00 115.64 116.68 1g3g s THR 109 Ca -0.08 -1.03 0.11 0.00 0.31 0.00 0.00 61.69 61.00 1g3g s THR 109 Cb -0.11 -1.62 -0.04 0.00 0.01 0.00 0.00 72.50 70.75 1g3g s THR 109 CO -0.08 0.54 -0.27 0.26 -0.69 0.00 0.00 174.62 174.39 1g3g s TRP 110 N -0.40 2.30 -0.22 4.92 0.51 0.50 -0.88 118.94 125.67 1g3g s TRP 110 Ca 0.04 -0.39 0.01 0.00 -2.12 0.00 0.00 56.10 53.65 1g3g s TRP 110 Cb -0.11 -1.27 0.05 0.00 -0.81 0.00 0.00 33.47 31.33 1g3g s TRP 110 CO 0.01 0.29 -0.09 -1.17 -0.51 0.00 0.00 176.95 175.48 1g3g s LEU 111 N -1.89 2.63 -1.61 2.99 2.96 -0.67 0.12 118.68 123.20 1g3g s LEU 111 Ca 0.13 -1.09 -0.11 0.00 -0.22 0.00 0.00 54.13 52.85 1g3g s LEU 111 Cb -0.10 -1.30 0.10 0.00 0.50 0.00 0.00 46.19 45.39 1g3g s LEU 111 CO 0.05 -0.18 0.52 0.59 -1.32 0.00 0.00 176.35 176.02 1g3g n ASN 112 N 4.62 -1.53 -0.26 3.68 3.02 0.82 -0.08 115.26 125.54 1g3g n ASN 112 Ca -0.14 -1.08 -0.03 0.00 -0.03 0.00 0.00 54.58 53.30 1g3g n ASN 112 Cb 0.45 -2.51 -0.01 0.00 -0.61 0.00 0.00 39.78 37.11 1g3g n ASN 112 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1g3g n GLY 113 N -1.73 0.39 2.53 7.41 0.00 -1.26 -5.01 105.19 107.51 1g3g n GLY 113 Ca -0.10 -0.85 -0.29 0.00 0.00 0.00 0.00 46.02 44.78 1g3g n GLY 113 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1g3g s GLN 114 N -3.39 0.44 0.12 1.61 0.74 0.89 -5.12 119.66 114.96 1g3g s GLN 114 Ca 0.00 -0.99 -0.34 0.00 0.05 0.00 0.00 55.36 54.08 1g3g s GLN 114 Cb 0.00 -1.35 -0.17 0.00 1.10 0.00 0.00 33.01 32.59 1g3g s GLN 114 CO 0.00 -1.10 1.06 1.17 -0.55 0.00 0.00 175.29 175.87 1g3g n LYS 115 N 4.62 0.69 -4.59 1.67 4.81 -1.26 -1.68 118.16 122.43 1g3g n LYS 115 Ca 0.03 0.25 -0.30 0.00 -0.87 0.00 0.00 58.31 57.41 1g3g n LYS 115 Cb 0.40 -1.69 -0.07 0.00 0.02 0.00 0.00 35.03 33.69 1g3g n LYS 115 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 1g3g n VAL 116 N 1.39 0.00 -3.04 3.15 0.24 -0.06 -4.84 118.33 115.17 1g3g n VAL 116 Ca 0.17 -2.42 -0.38 0.00 -2.04 0.00 0.00 64.34 59.67 1g3g n VAL 116 Cb 0.20 0.64 -0.06 0.00 -1.47 0.00 0.00 33.84 33.15 1g3g n VAL 116 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1g3g s GLU 117 N -3.73 4.44 0.92 7.34 0.41 -1.26 -4.45 118.70 122.37 1g3g s GLU 117 Ca 0.09 1.04 -0.11 0.00 -0.41 0.00 0.00 54.97 55.58 1g3g s GLU 117 Cb 0.00 -3.12 0.15 0.00 -1.78 0.00 0.00 34.13 29.38 1g3g s GLU 117 CO 0.06 0.51 1.10 0.21 -0.49 0.00 0.00 175.26 176.65 1g3g s LYS 118 N -1.44 0.99 -1.29 1.61 2.20 -1.26 -3.08 119.74 117.48 1g3g s LYS 118 Ca 0.38 1.12 -0.16 0.00 -0.36 0.00 0.00 55.97 56.95 1g3g s LYS 118 Cb -0.21 -1.76 0.16 0.00 -1.51 0.00 0.00 37.83 34.52 1g3g s LYS 118 CO 0.24 -2.51 0.41 0.09 -0.36 0.00 0.00 175.35 173.21 1g3g n ASN 119 N -4.11 -1.24 -4.32 1.43 3.02 0.24 -4.85 115.26 105.43 1g3g n ASN 119 Ca 0.08 -0.85 -0.36 0.00 -0.03 0.00 0.00 54.58 53.42 1g3g n ASN 119 Cb 0.54 -1.09 -0.13 0.00 -0.61 0.00 0.00 39.78 38.48 1g3g n ASN 119 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1g3g s SER 120 N -2.54 4.72 0.34 6.41 1.04 -1.18 -4.93 113.70 117.57 1g3g s SER 120 Ca 0.57 -0.58 -0.28 0.00 0.48 0.00 0.00 55.95 56.13 1g3g s SER 120 Cb -0.33 -1.80 -0.12 0.00 0.10 0.00 0.00 66.02 63.87 1g3g s SER 120 CO 0.70 -0.11 1.43 0.59 0.98 0.00 0.00 173.24 176.83 1g3g n ASN 121 N 4.81 3.37 -4.16 7.02 5.03 -1.26 -3.59 115.26 126.48 1g3g n ASN 121 Ca -0.16 1.20 -0.20 0.00 0.87 0.00 0.00 54.58 56.29 1g3g n ASN 121 Cb 0.49 -1.56 -0.13 0.00 -1.02 0.00 0.00 39.78 37.56 1g3g n ASN 121 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1g3g s GLN 122 N -1.69 0.97 -0.21 3.52 -1.52 0.47 -4.84 119.66 116.35 1g3g s GLN 122 Ca 0.56 -0.81 -0.29 0.00 -1.95 0.00 0.00 55.36 52.87 1g3g s GLN 122 Cb -0.52 -0.99 0.00 0.00 -0.22 0.00 0.00 33.01 31.28 1g3g s GLN 122 CO 0.60 0.24 1.10 -1.17 -0.25 0.00 0.00 175.29 175.81 1g3g s LEU 123 N -1.24 4.13 0.39 2.90 2.96 -1.26 0.14 118.68 126.69 1g3g s LEU 123 Ca 0.02 1.47 -0.24 0.00 -0.22 0.00 0.00 54.13 55.16 1g3g s LEU 123 Cb -0.08 -3.54 -0.13 0.00 0.50 0.00 0.00 46.19 42.94 1g3g s LEU 123 CO 0.02 -0.69 0.65 -0.11 -1.32 0.00 0.00 176.35 174.90 1g3g n LEU 124 N 6.34 0.35 -4.27 -0.68 7.94 -0.60 -4.85 117.00 121.23 1g3g n LEU 124 Ca 0.12 0.97 -0.21 0.00 -1.11 0.00 0.00 56.01 55.78 1g3g n LEU 124 Cb 0.46 -1.15 -0.12 0.00 0.53 0.00 0.00 43.42 43.15 1g3g n LEU 124 CO 0.53 -2.58 -0.48 -0.44 -1.11 0.00 0.00 177.39 173.31 1g3g s SER 125 N -0.88 2.33 -0.26 1.96 0.01 -1.26 -4.98 113.70 110.61 1g3g s SER 125 Ca 0.63 -0.75 -0.29 0.00 1.31 0.00 0.00 55.95 56.85 1g3g s SER 125 Cb -0.64 -0.12 -0.02 0.00 0.21 0.00 0.00 66.02 65.46 1g3g s SER 125 CO 0.58 -0.03 1.54 -1.10 0.41 0.00 0.00 173.24 174.64 1g3g s GLN 126 N -2.28 3.77 -1.28 12.44 -1.52 -1.26 -2.55 119.66 126.98 1g3g s GLN 126 Ca 0.08 1.49 -0.00 0.00 -1.95 0.00 0.00 55.36 54.98 1g3g s GLN 126 Cb -0.08 -4.01 0.00 0.00 -0.22 0.00 0.00 33.01 28.70 1g3g s GLN 126 CO 0.04 -1.32 0.02 0.41 -0.25 0.00 0.00 175.29 174.20 1g3g n GLY 127 N 4.67 -0.25 3.52 3.09 0.00 -1.22 -4.96 105.19 110.05 1g3g n GLY 127 Ca 0.18 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 1g3g n GLY 127 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1g3g n ASP 128 N -0.90 -1.05 -3.76 1.61 2.03 -1.06 -4.63 116.55 108.79 1g3g n ASP 128 Ca -0.17 0.36 -0.13 0.00 0.52 0.00 0.00 54.79 55.37 1g3g n ASP 128 Cb 0.63 -1.32 -0.13 0.00 -0.72 0.00 0.00 41.12 39.59 1g3g n ASP 128 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 1g3g s GLU 129 N -4.08 0.22 -0.16 -0.67 2.12 -1.26 -0.26 118.70 114.62 1g3g s GLU 129 Ca 0.61 0.41 -0.01 0.00 0.36 0.00 0.00 54.97 56.34 1g3g s GLU 129 Cb -0.22 -0.00 -0.01 0.00 0.26 0.00 0.00 34.13 34.16 1g3g s GLU 129 CO 0.63 -0.10 -0.10 0.42 -0.54 0.00 0.00 175.26 175.57 1g3g s ILE 130 N 0.69 3.15 -0.00 -3.70 1.09 0.14 -0.13 121.20 122.45 1g3g s ILE 130 Ca -0.05 -0.61 -0.01 0.00 -1.10 0.00 0.00 60.65 58.89 1g3g s ILE 130 Cb -0.06 -2.36 -0.04 0.00 -1.06 0.00 0.00 42.46 38.94 1g3g s ILE 130 CO -0.04 0.50 0.09 -0.89 -0.10 0.00 0.00 174.94 174.50 1g3g s THR 131 N 0.66 4.78 0.05 2.92 2.01 0.32 0.11 115.64 126.49 1g3g s THR 131 Ca -0.06 -0.40 -0.02 0.00 0.31 0.00 0.00 61.69 61.52 1g3g s THR 131 Cb -0.15 -3.19 -0.03 0.00 0.01 0.00 0.00 72.50 69.13 1g3g s THR 131 CO 0.02 0.34 0.01 0.68 -0.69 0.00 0.00 174.62 174.99 1g3g s VAL 132 N -1.21 0.19 -0.73 3.82 -7.23 0.51 0.19 120.40 115.93 1g3g s VAL 132 Ca 0.23 -1.54 -0.04 0.00 -1.81 0.00 0.00 61.98 58.82 1g3g s VAL 132 Cb -0.12 -1.26 0.00 0.00 0.56 0.00 0.00 36.38 35.56 1g3g s VAL 132 CO 0.15 -0.85 0.64 0.61 -0.31 0.00 0.00 175.10 175.33 1g3g n GLY 133 N 0.36 0.12 3.82 2.32 0.00 -1.26 0.22 105.19 110.78 1g3g n GLY 133 Ca -0.16 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.37 1g3g n GLY 133 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g3g s VAL 134 N -3.18 4.21 0.00 1.61 1.01 -1.26 -3.70 120.40 119.09 1g3g s VAL 134 Ca 0.28 1.10 0.00 0.00 0.00 0.00 0.00 61.98 63.36 1g3g s VAL 134 Cb -0.12 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.69 1g3g s VAL 134 CO 0.40 -0.56 0.00 0.61 0.00 0.00 0.00 175.10 175.55 1g3g n GLY 135 N -1.20 4.00 3.06 4.51 0.00 -1.26 -5.03 105.19 109.28 1g3g n GLY 135 Ca 0.08 -0.61 -0.26 0.00 0.00 0.00 0.00 46.02 45.22 1g3g n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g3g s VAL 136 N 0.00 1.35 0.43 1.61 1.01 -1.26 -5.02 120.40 118.52 1g3g s VAL 136 Ca 0.00 -0.60 0.20 0.00 0.00 0.00 0.00 61.98 61.58 1g3g s VAL 136 Cb 0.00 -1.22 0.40 0.00 0.00 0.00 0.00 36.38 35.56 1g3g s VAL 136 CO 0.00 0.40 1.84 -0.08 0.00 0.00 0.00 175.10 177.27 1g3g h GLU 137 N 6.98 0.33 -0.35 2.72 4.81 -1.99 0.40 114.58 127.49 1g3g h GLU 137 Ca -0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1g3g h GLU 137 Cb 1.20 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1g3g h GLU 137 CO 0.47 0.22 0.00 0.45 -0.73 0.00 0.00 179.01 179.42 1g3g n SER 138 N -4.49 2.56 -0.69 1.04 2.88 -1.26 -4.14 113.62 109.52 1g3g n SER 138 Ca 0.20 -1.90 0.06 0.00 -1.33 0.00 0.00 58.87 55.91 1g3g n SER 138 Cb 0.78 -0.23 0.13 0.00 -0.75 0.00 0.00 64.21 64.14 1g3g n SER 138 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1g3g n ASP 139 N 0.90 1.50 -4.81 -3.46 -0.08 0.14 -5.05 116.55 105.69 1g3g n ASP 139 Ca 0.17 -3.10 -0.36 0.00 -1.51 0.00 0.00 54.79 50.00 1g3g n ASP 139 Cb 0.45 -0.42 -0.07 0.00 2.34 0.00 0.00 41.12 43.42 1g3g n ASP 139 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1g3g s ILE 140 N -2.07 5.06 -0.05 5.18 1.01 -1.10 -4.42 121.20 124.80 1g3g s ILE 140 Ca 0.32 -0.04 0.06 0.00 0.00 0.00 0.00 60.65 60.99 1g3g s ILE 140 Cb 0.32 -3.22 -0.01 0.00 0.01 0.00 0.00 42.46 39.56 1g3g s ILE 140 CO -0.07 0.55 -0.23 -0.76 0.00 0.00 0.00 174.94 174.43 1g3g s LEU 141 N -1.18 2.04 0.08 2.97 2.01 0.13 -4.97 118.68 119.76 1g3g s LEU 141 Ca 0.17 -0.48 0.09 0.00 0.01 0.00 0.00 54.13 53.92 1g3g s LEU 141 Cb -0.12 -1.29 -0.03 0.00 0.01 0.00 0.00 46.19 44.76 1g3g s LEU 141 CO 0.06 0.23 -0.24 -0.44 1.01 0.00 0.00 176.35 176.97 1g3g s SER 142 N -0.14 2.90 0.05 2.29 0.01 -1.26 0.19 113.70 117.75 1g3g s SER 142 Ca -0.03 -0.64 0.06 0.00 1.31 0.00 0.00 55.95 56.65 1g3g s SER 142 Cb -0.13 -0.21 -0.03 0.00 0.21 0.00 0.00 66.02 65.86 1g3g s SER 142 CO 0.03 0.17 -0.18 -0.76 0.41 0.00 0.00 173.24 172.91 1g3g s LEU 143 N -1.61 2.19 -0.00 2.44 1.02 0.29 -3.87 118.68 119.14 1g3g s LEU 143 Ca 0.10 -0.53 0.04 0.00 0.02 0.00 0.00 54.13 53.77 1g3g s LEU 143 Cb -0.10 -0.79 -0.01 0.00 0.02 0.00 0.00 46.19 45.31 1g3g s LEU 143 CO 0.04 0.08 -0.14 -0.69 0.02 0.00 0.00 176.35 175.66 1g3g s VAL 144 N -0.90 1.10 -0.14 -1.59 1.01 -0.69 0.25 120.40 119.44 1g3g s VAL 144 Ca 0.04 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.37 1g3g s VAL 144 Cb -0.09 -0.93 -0.01 0.00 0.00 0.00 0.00 36.38 35.35 1g3g s VAL 144 CO 0.02 0.26 -0.16 -0.63 0.00 0.00 0.00 175.10 174.59 1g3g s ILE 145 N -0.42 2.71 -0.22 2.22 1.01 0.64 0.18 121.20 127.33 1g3g s ILE 145 Ca 0.05 -0.77 -0.04 0.00 0.00 0.00 0.00 60.65 59.89 1g3g s ILE 145 Cb -0.06 -2.13 -0.01 0.00 0.01 0.00 0.00 42.46 40.27 1g3g s ILE 145 CO -0.00 0.53 -0.03 0.12 0.00 0.00 0.00 174.94 175.55 1g3g s PHE 146 N 0.56 2.97 -0.17 3.97 5.36 0.48 -3.04 117.98 128.12 1g3g s PHE 146 Ca -0.10 -0.87 -0.09 0.00 -0.96 0.00 0.00 56.93 54.92 1g3g s PHE 146 Cb -0.16 -2.12 -0.05 0.00 -0.34 0.00 0.00 43.02 40.36 1g3g s PHE 146 CO 0.04 -0.52 0.12 0.42 -1.46 0.00 0.00 175.22 173.82 1g3g s ILE 147 N 1.47 5.37 -0.35 3.12 1.01 -1.26 0.75 121.20 131.30 1g3g s ILE 147 Ca 0.06 0.17 -0.26 0.00 0.00 0.00 0.00 60.65 60.62 1g3g s ILE 147 Cb -0.14 -3.40 0.01 0.00 0.01 0.00 0.00 42.46 38.94 1g3g s ILE 147 CO -0.02 0.51 0.91 0.54 0.00 0.00 0.00 174.94 176.87 1g3g s ASN 148 N -0.16 6.69 0.62 3.58 4.22 -1.26 -4.91 114.94 123.72 1g3g s ASN 148 Ca 0.10 0.62 0.42 0.00 -2.14 0.00 0.00 52.86 51.86 1g3g s ASN 148 Cb -0.11 -2.46 2.27 0.00 1.28 0.00 0.00 41.25 42.23 1g3g s ASN 148 CO 0.00 -0.81 2.28 -0.78 -2.04 0.00 0.00 177.10 175.75 1g3g h ASP 149 N 8.38 0.00 -0.71 3.54 3.58 -1.97 -2.29 116.42 126.95 1g3g h ASP 149 Ca -0.23 0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.26 1g3g h ASP 149 Cb 1.08 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.08 1g3g h ASP 149 CO 0.96 0.00 0.43 0.11 -2.88 0.00 0.00 179.24 177.87 1g3g h LYS 150 N 0.00 0.80 -0.50 0.28 1.57 -1.91 -1.65 116.57 115.16 1g3g h LYS 150 Ca 0.00 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1g3g h LYS 150 Cb 0.00 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.11 1g3g h LYS 150 CO 0.00 0.53 0.28 0.35 -0.57 0.00 0.00 179.45 180.04 1g3g h PHE 151 N 0.82 0.67 -1.00 -1.35 3.57 -1.48 -2.59 116.94 115.59 1g3g h PHE 151 Ca 0.30 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.80 1g3g h PHE 151 Cb 0.09 -0.22 -0.05 0.00 2.79 0.00 0.00 35.95 38.56 1g3g h PHE 151 CO -0.05 0.48 0.66 -0.22 -2.23 0.00 0.00 178.31 176.95 1g3g h LYS 152 N 0.66 1.32 -0.96 1.11 3.64 -1.53 -2.11 116.57 118.70 1g3g h LYS 152 Ca 0.18 -0.08 0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1g3g h LYS 152 Cb 0.02 -0.30 -0.05 0.00 -0.41 0.00 0.00 32.23 31.50 1g3g h LYS 152 CO -0.03 0.88 0.64 0.37 -2.27 0.00 0.00 179.45 179.04 1g3g h GLN 153 N 1.36 1.25 -0.26 1.90 4.15 -0.94 0.26 115.11 122.83 1g3g h GLN 153 Ca 0.37 -0.08 -0.05 0.00 0.77 0.00 0.00 58.65 59.66 1g3g h GLN 153 Cb -0.15 -0.28 -0.01 0.00 0.21 0.00 0.00 27.48 27.25 1g3g h GLN 153 CO -0.08 0.83 -0.02 0.00 -1.93 0.00 0.00 178.83 177.63 1g3g h LEU 155 N 0.24 1.01 -1.12 0.00 7.12 -1.03 0.73 115.31 122.26 1g3g h LEU 155 Ca 0.07 -0.36 0.07 0.00 0.13 0.00 0.00 57.88 57.79 1g3g h LEU 155 Cb 0.46 -0.27 -0.06 0.00 -0.53 0.00 0.00 40.66 40.26 1g3g h LEU 155 CO 0.02 1.13 0.60 -0.08 -0.13 0.00 0.00 178.44 179.98 1g3g h GLU 156 N 0.87 1.02 0.03 1.25 4.57 -0.43 -2.55 114.58 119.34 1g3g h GLU 156 Ca 0.13 -0.06 -0.30 0.00 -1.18 0.00 0.00 59.36 57.95 1g3g h GLU 156 Cb 0.69 -0.23 -0.04 0.00 -0.16 0.00 0.00 28.75 29.01 1g3g h GLU 156 CO 0.05 0.68 -1.73 1.96 -1.18 0.00 0.00 179.01 178.78 1g3g h GLN 157 N 1.05 0.06 -6.44 1.92 1.08 -1.30 -3.50 115.11 107.99 1g3g h GLN 157 Ca 0.40 -0.11 -0.36 0.00 -1.45 0.00 0.00 58.65 57.14 1g3g h GLN 157 Cb 0.21 0.04 0.02 0.00 -0.05 0.00 0.00 27.48 27.70 1g3g h GLN 157 CO -0.16 0.68 -1.14 0.27 -0.95 0.00 0.00 178.83 177.53 1g3g n ASN 158 N -3.16 -5.73 -4.09 1.46 0.23 0.25 -4.97 115.26 99.26 1g3g n ASN 158 Ca -0.19 -0.12 -0.32 0.00 -0.53 0.00 0.00 54.58 53.42 1g3g n ASN 158 Cb 1.05 -2.03 -0.16 0.00 -2.08 0.00 0.00 39.78 36.56 1g3g n ASN 158 CO 0.00 0.00 0.00 -1.59 -0.93 0.00 0.00 177.26 174.74 1g3g s LYS 159 N -2.56 2.61 0.02 -3.83 -2.85 -1.26 -5.08 119.74 106.80 1g3g s LYS 159 Ca 0.36 -1.01 -0.26 0.00 -1.00 0.00 0.00 55.97 54.06 1g3g s LYS 159 Cb -0.04 -2.66 -0.05 0.00 -2.06 0.00 0.00 37.83 33.02 1g3g s LYS 159 CO 0.87 -0.36 0.80 0.08 0.10 0.00 0.00 175.35 176.83 1g3g s VAL 160 N 1.23 4.79 -0.16 1.79 1.01 -1.26 -5.05 120.40 122.75 1g3g s VAL 160 Ca -0.01 1.69 0.01 0.00 0.00 0.00 0.00 61.98 63.67 1g3g s VAL 160 Cb -0.16 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.08 1g3g s VAL 160 CO -0.10 0.31 -0.17 -1.81 0.00 0.00 0.00 175.10 173.34 1g3g s ASP 161 N 0.26 3.50 -0.22 3.32 1.01 -1.26 -5.11 116.67 118.17 1g3g s ASP 161 Ca 0.41 -0.52 -0.11 0.00 0.71 0.00 0.00 52.55 53.03 1g3g s ASP 161 Cb -0.20 -1.54 -0.05 0.00 1.01 0.00 0.00 42.92 42.14 1g3g s ASP 161 CO 0.23 0.06 0.19 -0.60 0.21 0.00 0.00 175.17 175.26 1g3g s ARG 162 N 0.95 4.11 -0.17 8.23 3.52 -1.26 -5.08 118.95 129.25 1g3g s ARG 162 Ca -0.03 -0.18 -0.06 0.00 -0.13 0.00 0.00 55.73 55.32 1g3g s ARG 162 Cb -0.15 -3.51 -0.04 0.00 -1.56 0.00 0.00 34.95 29.69 1g3g s ARG 162 CO -0.03 0.10 0.03 -1.50 -0.81 0.00 0.00 175.30 173.09 1g3g s ILE 163 N 0.94 4.48 0.00 4.11 2.07 -1.26 -5.32 121.20 126.23 1g3g s ILE 163 Ca 0.09 -0.14 0.00 0.00 -1.41 0.00 0.00 60.65 59.19 1g3g s ILE 163 Cb -0.13 -3.01 0.00 0.00 0.13 0.00 0.00 42.46 39.45 1g3g s ILE 163 CO 0.04 0.47 0.45 -2.11 -1.91 0.00 0.00 174.94 171.88